Structure Information
Structure

Compound Identification

SMILES

CC1=CN([C@H]2C[C@H](OP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3O)N3C=NC4=C3NC(N)=NC4=O)[C@@H](COP(O)(O)=O)O2)C(=O)N=C1N

InChIKey

InChIKey=GQIYDXHUXPQDHN-PRSXHHODSA-N

Formula

C20H28N8O13P2

Mass

650.435

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Nucleosides, nucleotides, and analogues

Class

Pyrimidine nucleotides

Subclass

Pyrimidine deoxyribonucleotides

Intermediate Tree Nodes

Pyrimidine deoxyribonucleoside bisphosphates

Direct Parent

Pyrimidine deoxyribonucleoside 3',5'-bisphosphates

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pyrimidine deoxyribonucleoside 3',5'-bisphosphate - Ribonucleoside 3'-phosphate - Pentose phosphate - Hypoxanthine - Alpha-amino acid or derivatives - 6-oxopurine - Imidazopyrimidine - Dialkyl phosphate - Monoalkyl phosphate - Pyrimidone - Imidolactam - Alkyl phosphate - Pyrimidine - Phosphoric acid ester - Organic phosphoric acid derivative - N-substituted imidazole - Monosaccharide - 1,2-dihydropyrimidine - Hydropyrimidine - Heteroaromatic compound - Vinylogous amide - Tetrahydrofuran - Azole - N-acylimine - Secondary alcohol - Carbonic acid derivative - Guanidine - Amino acid or derivatives - Formamidine - Oxacycle - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Carboxylic acid derivative - Amidine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Amine - Alcohol - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrimidine deoxyribonucleoside 3',5'-bisphosphates. These are pyrimidine ribobucleotides with one phosphate group attached to each of two different hydroxyl groups of the ribose moiety, which lacks a hydroxyl group at position 2.

External Descriptors

Not available

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